3,4-DIAMINO-5-HYDRO...

3,4-DIAMINO-5-HYDROXYPYRAZOL SULFAT 52057-97-3

3,4-DIAMINO-5-HYDROXYPYRAZOL SULFAT 52057-97-3

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1 Gram

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  • Min.Order :1 Gram
  • Purity: 99%
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Keywords

4,5-diamino-1,2-dihydropyrazol-3-one 3,4-DIAMINO-5-HYDROXYPYRAZOL SULFAT 52057-97-3

Quick Details

  • Appearance:Solid
  • Application:Organic Chemicals
  • PackAge:as requested
  • ProductionCapacity:1|Metric Ton|Month
  • Storage:Room Temperature
  • Transportation:as requested

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Details:

Identification and Related Records
【Name】
4,5-diamino-1,2-dihydropyrazol-3-one
【CAS Registry number】
52057-97-3
【Synonyms】
3,4-DIAMINO-5-HYDROXYPYRAZOL SULFAT
3,4-Diamino-5-pyrazolol sulfate
3,4-diaminopyrazole-5-ol sulphate
3,4-Diamino-5-HydroxypyrazoleSulphate,>95%
【EINECS(EC#)】
306-626-3
【Molecular Formula】
C3H6N4O (Products with the same molecular formula)
【Molecular Weight】
212.18442
【Inchi】
InChI=1/C3H6N4O/c4-1-2(5)6-7-3(1)8/h4H2,(H4,5,6,7,8)
【Canonical SMILES】
C1(=C(NNC1=O)N)N
【MOL File】
52057-97-3.mol
Chemical and Physical Properties
【Density】
1.396g/cm3
【Melting Point】
208 °C
【Boiling Point】
521.5°C at 760 mmHg
【Refractive Index】
1.584
【Flash Point】
269.2°C
【Computed Properties】
Molecular Weight:114.10594 [g/mol]
Molecular Formula:C3H6N4O
XLogP3-AA:-1.2
H-Bond Donor:4
H-Bond Acceptor:4
Rotatable Bond Count:0
Tautomer Count:17
Exact Mass:114.054161
MonoIsotopic Mass:114.054161
Topological Polar Surface Area:93.2
Heavy Atom Count:8
Formal Charge:0
Complexity:161
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:4
Feature 3D Cation Count:2
Feature 3D Ring Count:1
Effective Rotor Count:0
Conformer Sampling RMSD:0.4
CID Conformer Count:1

 

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